methyl 4-[[3-acetyloxy-1-[[2-[(4-nitrophenyl)methoxy]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl 4-[[3-acetyloxy-1-[[2-[(4-nitrophenyl)methoxy]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl 4-[[1-(acetoxymethyl)-2-[[2-[(4-nitrophenyl)methoxy]-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-3-(benzyloxycarbonylamino)-4-oxo-butanoate CAS Name: 4-[[3-acetyloxy-1-[[2-[(4-nitrophenyl)methoxy]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl 4-[[3-acetyloxy-1-[[2-[(4-nitrophenyl)methoxy]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoate Traditional Name: 4-[[1-(acetoxymethyl)-2-keto-2-[[2-keto-2-(4-nitrobenzyl)oxy-ethyl]amino]ethyl]amino]-3-(benzyloxycarbonylamino)-4-keto-butyric acid methyl ester Formula: C27H30N4O12 MolecularWeight: 602.5467

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(=O)NCC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CC(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OCC(C(=O)NCC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CC(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H30N4O12/c1-17(32)41-16-22(25(35)28-13-24(34)42-14-19-8-10-20(11-9-19)31(38)39)29-26(36)21(12-23(33)40-2)30-27(37)43-15-18-6-4-3-5-7-18/h3-11,21-22H,12-16H2,1-2H3,(H,28,35)(H,29,36)(H,30,37)